| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 18 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.64 | 6.03 | -52.9 | 0 | 3 | -1 | 45 | 240.282 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.64 | 5.26 | -8.8 | 1 | 3 | 0 | 42 | 241.29 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.64 | 5.61 | -32.95 | 2 | 3 | 1 | 43 | 242.298 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
